CS-1176283
3-Chloro-4-(1-propyn-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 2620086-32-8
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₀H₆ClN
Molecular Weight
175.61
Synonyms
None
SMILES
N#CC1=CC=C(C#CC)C(Cl)=C1
Tpsa
23.79
Logp
2.58308
H Acceptors
1
H Donors
0
Rotatable Bonds
0
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₆ClN
Molecular Weight: 175.61
Synonyms: None
SMILES: N#CC1=CC=C(C#CC)C(Cl)=C1
Tpsa: 23.79
Logp: 2.58308
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₆ClN
Molecular Weight:
175.61
Synonyms:
None
SMILES:
N#CC1=CC=C(C#CC)C(Cl)=C1
Tpsa:
23.79
Logp:
2.58308
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₂N₂O₂
Molecular Weight: 144.17
Synonyms: None
SMILES: O=C([C@H]1NC[C@H](N)CC1)O
Tpsa: 75.35
Logp: -0.8497
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₂N₂O₂
Molecular Weight:
144.17
Synonyms:
None
SMILES:
O=C([C@H]1NC[C@H](N)CC1)O
Tpsa:
75.35
Logp:
-0.8497
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃Cl₂F₂N₃
Molecular Weight: 238.02
Synonyms: None
SMILES: FC(N1C=NC2=CC(Cl)=C(Cl)N=C21)F
Tpsa: 30.71
Logp: 3.1332
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃Cl₂F₂N₃
Molecular Weight:
238.02
Synonyms:
None
SMILES:
FC(N1C=NC2=CC(Cl)=C(Cl)N=C21)F
Tpsa:
30.71
Logp:
3.1332
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀F₃NO₂
Molecular Weight: 221.18
Synonyms: None
SMILES: O=C1C=C(C(F)(F)F)C(CCOC)=CN1
Tpsa: 42.09
Logp: 1.5826
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₀F₃NO₂
Molecular Weight:
221.18
Synonyms:
None
SMILES:
O=C1C=C(C(F)(F)F)C(CCOC)=CN1
Tpsa:
42.09
Logp:
1.5826
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3